Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GSK3A | P49840 | 19/20 | 0.65 |
| ▸ | GSK3B | P49841 | 19/20 | 0.65 |
| ▸ | CDK1 | P06493 | 18/20 | 0.65 |
| ▸ | CCNB2 | O95067 | 17/20 | 0.65 |
| ▸ | CCNB1 | P14635 | 17/20 | 0.65 |
| ▸ | CCNB3 | Q8WWL7 | 17/20 | 0.65 |
| ▸ | CDK5 | Q00535 | 11/20 | 0.50 |
| ▸ | CDK5R1 | Q15078 | 10/20 | 0.50 |
| ▸ | MAPK8 | P45983 | 3/20 | 0.49 |
| ▸ | CDK2 | P24941 | 3/20 | 0.49 |
| ▸ | AURKA | O14965 | 2/20 | 0.49 |
| ▸ | MAP4K4 | O95819 | 2/20 | 0.49 |
| ▸ | PAK4 | O96013 | 2/20 | 0.49 |
| ▸ | ABL1 | P00519 | 2/20 | 0.49 |
| ▸ | FYN | P06241 | 2/20 | 0.49 |
| ▸ | RET | P07949 | 2/20 | 0.49 |
| ▸ | KDR | P35968 | 2/20 | 0.49 |
| ▸ | CDK8 | P49336 | 2/20 | 0.49 |
| ▸ | ACVR1 | Q04771 | 2/20 | 0.49 |
| ▸ | PTK2 | Q05397 | 2/20 | 0.49 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| Iodide SCHEMBL1777519 | 0.99 | GSK3A (0.63) | GSK3AGSK3BCDK1CCNB2CCNB1 | |
| Iodide SCHEMBL1778660 | 0.85 | MAPK14 (0.52) | GSK3AGSK3BCDK1CCNB2CCNB1 | |
| Iodide SCHEMBL5618949 | 0.82 | GSK3A (0.60) | GSK3AGSK3BCDK1CCNB2CCNB1 | |
| Iodide SCHEMBL1779435 | 0.82 | GSK3A (0.69) | GSK3AGSK3BCDK1CCNB2CCNB1 | |
| Iodide SCHEMBL27615998 | 0.82 | GSK3A (0.60) | GSK3AGSK3BCDK1CCNB2CCNB1 | |
| SCHEMBL1777880 | 0.79 | GSK3A (0.65) | GSK3AGSK3BCDK1CCNB2CCNB1 | |
| Iodide SCHEMBL6852377 | 0.79 | GSK3A (0.58) | GSK3AGSK3BCDK1CCNB2CCNB1 | |
| Iodide SCHEMBL1778365 | 0.79 | GSK3A (0.52) | GSK3AGSK3BCDK1CCNB2CCNB1 | |
| SCHEMBL490379 | 0.79 | GSK3A (1.00) | GSK3AGSK3BCDK1CCNB2CCNB1 | |
| SCHEMBL1778259 | 0.78 | GSK3A (0.67) | GSK3AGSK3BCDK1CCNB2CCNB1 |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1263759-A2 | AZAINDOLES | Aventis Pharma Limited (GB) | 2002-12-11 | — | — | EP | disclosed |
| WO-2001047922-A2 | AZAINDOLES | AVENTIS PHARMA LIMITED (GB) | 2001-07-05 | — | — | WO | disclosed |